Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.2905 -0.3537 -0.1346 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5496 0.2551 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2889 0.7699 0.6613 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7336 0.0186 0.1179 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5102 -1.2068 -0.0607 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0207 0.5651 -0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9563 -0.1945 -0.7597 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3500 2.2563 -0.0083 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.3172 -1.4695 -0.0868 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8429 -0.0762 -1.1163 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3492 -0.0211 -0.1681 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1400 1.0995 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4897 -0.5150 1.8161 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7668 -1.2676 -0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9305 0.1400 -1.0527 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers